N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide

C14H24N2O3S2 — CID 16887639

IUPACN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide
SMILESCOCCN1CCC(CNS(=O)(=O)c2ccc(C)s2)CC1
InChIInChI=1S/C14H24N2O3S2/c1-12-3-4-14(20-12)21(17,18)15-11-13-5-7-16(8-6-13)9-10-19-2/h3-4,13,15H,5-11H2,1-2H3
InChIKeyXHNWACUDTCPZPC-UHFFFAOYSA-N
MW332.49 g/mol
LogP1.69
Rot. Bonds7

About N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide

N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide (PubChem CID 16887639) has the molecular formula C14H24N2O3S2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide
PubChem CID16887639
Molecular FormulaC14H24N2O3S2
Molecular Weight332.49 g/mol
Exact Mass332.12
IUPAC NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide
SMILESCOCCN1CCC(CNS(=O)(=O)c2ccc(C)s2)CC1
InChIInChI=1S/C14H24N2O3S2/c1-12-3-4-14(20-12)21(17,18)15-11-13-5-7-16(8-6-13)9-10-19-2/h3-4,13,15H,5-11H2,1-2H3
InChIKeyXHNWACUDTCPZPC-UHFFFAOYSA-N
XLogP1.69
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Methyl-2-(morpholin-4-ylsulfonyl)thiophene
CID 2090984
5-methyl-N-[2-(4-morpholinyl)ethyl]-2-thiophenesulfonamide
CID 2241010
(5-(Morpholine-4-sulfonyl)thiophen-2-yl)methanamine
CID 16227260
2,5-dimethyl-N-(2-morpholin-4-ylethyl)thiophene-3-sulfonamide
CID 6602862
N-[(1-cyclopentylpiperidin-4-yl)methyl]-5-ethylthiophene-2-sulfonamide
CID 16887719
2,5-dimethyl-N-[2-(morpholin-4-yl)ethyl]thiophene-3-sulfonamide
CID 715945
[5-(Morpholine-4-sulfonyl)thiophen-2-yl]methanamine hydrochloride
CID 16340542
5-methyl-N-{[1-(propan-2-yl)piperidin-4-yl]methyl}thiophene-2-sulfonamide
CID 16887552
N-((1-(2-methoxyethyl)piperidin-4-yl)methyl)thiophene-2-sulfonamide
CID 16887598
5-ethyl-N-((1-(2-methoxyethyl)piperidin-4-yl)methyl)thiophene-2-sulfonamide
CID 16887634
N-[(1-cyclopentylpiperidin-4-yl)methyl]-5-methylthiophene-2-sulfonamide
CID 16887724
5-ethyl-N-(4-morpholinobut-2-yn-1-yl)thiophene-2-sulfonamide
CID 71792745

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide?
The IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide (CID 16887639) is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide is COCCN1CCC(CNS(=O)(=O)c2ccc(C)s2)CC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide?
The InChIKey is XHNWACUDTCPZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S2/c1-12-3-4-14(20-12)21(17,18)15-11-13-5-7-16(8-6-13)9-10-19-2/h3-4,13,15H,5-11H2,1-2H3.
What are the key properties of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide?
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide has a molecular weight of 332.49 g/mol, XLogP of 1.69, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-5-methylthiophene-2-sulfonamide is sourced from PubChem (CID 16887639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).